| SpectraBase Spectrum ID |
cxqwDDybx1 |
| Name |
Isosafrole |
| Alternate Name(s) |
1,3-Benzodioxole, 5-(1-propenyl)-
(E)-5-(prop-1-en-1-yl)benzo[d][1,3]dioxole |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H10O2 |
| InChI |
InChI=1S/C10H10O2/c1-2-3-8-4-5-9-10(6-8)12-7-11-9/h2-6H,7H2,1H3/b3-2+ |
| InChIKey |
VHVOLFRBFDOUSH-NSCUHMNNSA-N |
| Molecular Weight |
162.188 g/mol |
| SMILES |
C\C=C\c1cc2c(cc1)OCO2 |
| SPLASH |
splash10-0w29-6900000000-57140f9507968400023d |
| Source of Spectrum |
SWG-33-1272-0 |
| Wiley ID |
1809103 |
